# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 M C C 107.45 7.09 13.78 22.00 115.17 -162.24 -93.18 128.93 99.81 0.16 0.03 99.72 0.12 0.04 0.01 0.00 0.00 0.08 0.03 1 A C C 67.98 6.12 11.13 18.74 112.03 -137.97 -89.47 132.12 90.63 4.34 5.03 87.39 1.40 1.90 4.36 0.57 0.00 1.59 2.80 2 T C C 66.50 8.00 10.03 19.33 112.38 -123.24 -80.09 138.42 76.71 0.99 22.30 59.70 10.15 5.26 22.04 1.96 0.00 0.42 0.48 3 P C H 89.17 3.61 13.26 18.11 98.33 -115.26 -65.85 -32.52 51.59 0.72 47.69 33.37 5.70 12.44 43.29 4.50 0.00 0.35 0.34 4 S H H 62.95 4.32 14.33 19.71 98.21 51.48 -73.10 -31.21 35.18 0.82 64.00 20.86 4.96 10.83 56.55 5.99 0.02 0.42 0.36 5 L H H 49.26 13.74 11.75 25.73 93.72 57.38 -66.74 -37.90 12.40 0.36 87.24 6.66 2.52 4.51 79.90 6.06 0.02 0.21 0.12 6 R H H 128.09 5.93 15.53 22.74 92.26 55.01 -63.78 -39.96 7.31 0.17 92.53 3.00 1.21 3.55 87.26 4.81 0.02 0.11 0.05 7 G H H 37.78 2.44 17.18 19.58 92.53 50.87 -64.34 -40.46 7.63 0.15 92.22 2.54 1.18 4.29 86.40 5.42 0.02 0.10 0.05 8 R H H 86.04 9.01 15.30 25.42 92.65 50.79 -66.42 -39.70 7.36 0.16 92.48 2.36 1.13 4.23 86.62 5.49 0.03 0.10 0.05 9 L H H 46.53 13.72 12.87 27.05 92.62 51.95 -66.11 -36.98 9.76 0.22 90.02 2.85 1.53 5.82 83.73 5.81 0.05 0.13 0.08 10 A H H 72.57 3.12 16.63 20.35 91.80 57.42 -68.33 -25.33 25.72 0.36 73.92 5.31 3.38 17.59 68.24 5.02 0.08 0.18 0.19 11 R C H 148.54 3.41 15.00 19.33 95.63 59.74 -82.50 -8.36 50.99 1.00 48.02 13.48 7.49 31.27 41.21 5.41 0.10 0.44 0.59 12 L C C 69.75 12.42 9.90 22.44 105.85 93.80 -77.24 88.24 73.38 1.61 25.01 33.67 13.66 26.28 20.59 4.17 0.02 0.65 0.95 13 G C C 56.89 2.57 14.75 18.02 103.25 -122.02 24.24 9.17 91.55 1.19 7.26 46.21 18.87 26.95 3.86 2.86 0.00 0.51 0.73 14 N C C 75.39 7.59 9.72 18.81 115.17 116.73 -101.41 121.51 98.35 1.07 0.58 74.37 22.29 1.58 0.24 0.29 0.00 0.38 0.84 15 P C C 107.45 3.02 11.67 16.22 96.20 -148.36 -69.82 -16.52 98.14 0.44 1.42 34.02 30.63 33.41 0.20 1.32 0.00 0.22 0.20 16 R C S 157.06 2.43 12.62 16.48 115.91 85.55 -88.69 140.43 98.01 0.81 1.18 29.62 43.68 24.59 0.15 1.19 0.00 0.41 0.36 17 R C C 149.23 5.26 13.37 20.41 113.70 -107.80 -78.60 132.74 98.38 1.35 0.27 65.18 32.56 0.76 0.08 0.17 0.00 0.53 0.73 18 P C C 44.83 14.75 10.74 25.61 114.61 -112.37 -69.99 145.13 98.38 1.40 0.22 96.36 1.86 0.40 0.06 0.10 0.00 0.73 0.49 19 I C C 102.68 5.10 18.11 23.93 111.54 -128.07 -86.08 125.74 94.58 5.13 0.29 80.30 13.36 0.89 0.10 0.19 0.00 2.17 2.99 20 L C C 59.02 15.63 10.52 25.87 116.27 -145.04 -94.00 130.92 90.64 9.12 0.25 79.06 10.95 0.55 0.10 0.15 0.00 3.51 5.68 21 K C C 130.81 4.03 17.37 22.67 117.40 -161.67 -114.17 123.08 97.52 2.41 0.07 94.09 3.58 0.16 0.02 0.03 0.00 1.46 0.65 22 P C C 62.21 12.53 12.03 24.93 114.44 -114.65 -68.12 146.33 97.00 2.37 0.63 91.67 3.80 1.69 0.16 0.39 0.00 1.26 1.04 23 N C C 105.70 5.55 15.19 21.88 101.57 -145.26 -88.02 6.11 98.24 1.13 0.63 58.70 36.65 2.94 0.14 0.45 0.00 0.45 0.68 24 K C S 107.74 5.99 15.51 22.90 127.42 43.60 -119.72 145.71 97.08 1.97 0.95 29.90 66.49 1.20 0.33 0.41 0.00 0.85 0.81 25 P C C 72.77 8.10 17.10 26.04 115.37 -96.26 -67.46 149.36 95.59 2.30 2.11 87.70 6.26 1.90 0.55 1.41 0.00 1.50 0.69 26 L C C 38.58 19.27 13.18 32.02 113.46 -110.82 -78.00 135.07 85.68 11.35 2.97 79.62 4.32 1.60 1.40 1.50 0.00 7.49 4.06 27 I C C 85.73 8.02 21.60 30.25 120.72 -160.96 -114.05 132.79 73.24 23.82 2.94 64.32 5.84 1.43 2.13 1.10 0.00 14.69 10.49 28 L C C 38.07 19.22 13.18 31.76 115.15 -138.28 -87.51 134.60 79.16 16.04 4.80 69.11 6.81 2.59 2.77 2.15 0.00 11.49 5.07 29 A C C 48.28 8.27 18.02 27.03 113.75 -126.62 -76.90 158.30 82.99 4.38 12.62 50.71 20.17 12.53 6.11 6.24 0.01 2.77 1.46 30 N C C 99.84 7.25 17.30 25.30 100.94 -93.59 -80.98 13.07 80.02 3.21 16.76 33.09 29.11 18.98 7.69 8.05 0.04 1.74 1.29 31 H C C 95.36 8.36 18.42 27.39 121.42 73.28 -117.81 138.59 72.74 10.85 16.41 51.50 11.49 9.19 9.30 7.35 0.03 6.59 4.56 32 V C C 39.30 16.66 13.78 29.93 112.19 -147.33 -93.57 121.49 67.40 10.52 22.08 43.90 12.81 10.86 14.75 7.30 0.07 6.46 3.86 33 G C C 27.90 10.59 16.09 27.22 112.39 35.57 -81.94 49.17 70.62 5.51 23.87 38.77 15.67 16.53 14.31 9.30 0.04 3.41 1.98 34 E C C 105.94 6.80 15.60 23.26 102.23 -70.30 -82.81 15.65 69.14 2.57 28.29 33.69 17.14 19.04 15.58 12.00 0.05 1.23 1.29 35 R C C 120.78 7.91 12.71 21.72 103.47 89.67 -80.69 0.73 66.60 2.05 31.35 29.67 17.23 20.56 18.05 12.36 0.05 0.91 1.17 36 R C C 128.60 6.54 12.02 19.88 106.56 74.30 -83.89 76.17 69.53 2.41 28.06 39.70 14.47 15.64 16.89 10.82 0.02 1.11 1.33 37 R C C 150.54 4.23 12.20 17.88 103.66 61.30 -80.54 9.64 71.17 2.34 26.49 40.08 16.31 15.10 16.88 9.29 0.02 1.10 1.23 38 E C C 117.31 4.86 10.63 17.14 109.97 75.82 -88.23 107.36 75.02 2.29 22.69 41.94 17.95 15.32 14.66 7.78 0.01 1.03 1.28 39 K C C 146.52 3.13 11.84 16.53 107.43 -113.34 -82.54 104.87 80.75 1.57 17.68 42.05 17.67 21.37 11.16 6.11 0.01 0.69 0.95 40 G C C 51.52 3.87 13.33 18.54 106.37 9.38 80.20 0.39 85.73 1.27 13.00 37.55 24.50 24.30 7.13 5.20 0.00 0.52 0.80 41 E C C 103.02 7.35 13.51 22.04 109.24 91.09 -86.12 108.29 79.78 2.55 17.67 45.81 23.58 10.64 13.06 4.40 0.01 1.06 1.44 42 A C C 45.07 10.82 15.28 26.81 110.10 -117.69 -82.55 124.42 75.17 2.94 21.89 57.18 11.73 5.09 20.80 2.57 0.00 1.37 1.25 43 T C C 50.05 10.31 19.11 29.95 108.36 -148.44 -81.10 147.83 58.87 3.14 37.99 45.90 7.08 5.25 37.03 2.09 0.01 1.49 1.14 44 C H H 26.26 19.07 17.17 35.11 95.07 -80.77 -66.29 -37.65 25.57 0.98 73.45 15.67 5.47 4.77 72.11 1.16 0.01 0.47 0.33 45 I H H 64.49 11.51 20.55 32.08 92.71 53.96 -65.14 -40.94 3.83 0.09 96.07 2.04 0.52 1.14 95.85 0.38 0.00 0.04 0.03 46 T H H 62.08 6.17 23.15 29.46 92.18 51.00 -65.30 -41.07 1.13 0.02 98.84 0.60 0.12 0.38 98.66 0.22 0.00 0.01 0.00 47 E H H 29.34 17.22 20.26 37.13 92.24 50.67 -64.89 -41.96 0.40 0.01 99.60 0.16 0.03 0.17 99.53 0.11 0.00 0.00 0.00 48 M H H 24.66 19.45 20.23 39.00 91.83 50.64 -63.86 -41.26 0.19 0.00 99.81 0.06 0.01 0.09 99.80 0.04 0.00 0.00 0.00 49 S H H 47.41 7.12 23.85 31.38 91.55 51.77 -63.53 -41.22 0.11 0.00 99.89 0.02 0.00 0.05 99.90 0.02 0.00 0.00 0.00 50 V H H 49.71 9.82 23.46 33.68 91.74 50.13 -64.52 -42.10 0.06 0.00 99.94 0.01 0.00 0.04 99.94 0.01 0.00 0.00 0.00 51 M H H 11.53 22.16 19.87 41.55 91.63 50.45 -63.89 -42.56 0.07 0.00 99.93 0.00 0.00 0.04 99.93 0.01 0.00 0.00 0.00 52 M H H 50.81 13.88 22.00 35.65 91.31 50.50 -63.33 -41.62 0.11 0.00 99.89 0.01 0.00 0.07 99.89 0.03 0.00 0.00 0.00 53 A H H 46.32 4.24 23.75 27.88 91.44 51.37 -63.58 -41.43 0.33 0.00 99.67 0.02 0.01 0.24 99.63 0.09 0.00 0.00 0.00 54 C H H 14.99 13.39 18.19 33.14 91.46 50.28 -64.48 -41.52 1.06 0.00 98.94 0.08 0.06 0.81 98.78 0.26 0.00 0.00 0.00 55 W H H 33.59 18.30 15.13 33.38 92.18 51.64 -64.47 -39.90 2.90 0.02 97.09 0.51 0.30 1.98 96.36 0.82 0.01 0.00 0.01 56 K H H 123.29 4.60 18.26 23.73 92.13 53.78 -65.23 -37.08 7.19 0.03 92.78 0.82 0.60 5.69 91.74 1.10 0.02 0.01 0.02 57 Q H H 117.78 2.86 17.68 20.65 94.79 47.52 -81.39 -23.55 17.62 0.06 82.33 1.42 1.73 14.56 81.00 1.19 0.04 0.02 0.05 58 N C T 57.59 11.08 12.46 24.42 101.44 33.64 -108.50 15.64 67.69 0.58 31.73 9.49 11.44 45.67 30.47 2.26 0.05 0.18 0.44 59 E C T 122.48 4.56 18.54 23.95 95.99 -121.45 57.66 38.67 90.52 0.51 8.97 22.85 9.58 58.81 5.22 2.99 0.00 0.24 0.31 60 F C C 64.75 16.58 12.85 29.05 94.17 -70.44 62.71 30.91 88.64 1.59 9.77 51.17 14.76 23.11 4.49 4.63 0.00 0.67 1.16 61 R C C 123.41 4.58 18.53 24.05 109.58 143.98 -90.75 110.70 93.32 1.29 5.39 77.76 9.73 5.80 3.00 2.14 0.00 0.51 1.06 62 D C H 70.11 12.68 12.52 25.22 97.33 -168.41 -70.31 -28.25 49.82 0.99 49.19 20.50 17.06 14.31 35.34 11.67 0.07 0.36 0.69 63 E H H 140.98 1.47 18.69 19.25 92.49 62.41 -65.38 -35.86 23.39 0.12 76.50 1.88 2.50 16.71 48.08 30.61 0.09 0.06 0.07 64 A H H 45.81 7.63 16.24 25.22 92.28 50.98 -69.52 -32.06 21.42 0.08 78.51 1.08 1.54 16.82 51.15 29.21 0.11 0.04 0.05 65 C H H 10.02 20.30 10.87 31.05 97.57 44.84 -94.03 -7.67 25.02 0.11 74.88 2.02 1.90 18.99 51.97 24.95 0.05 0.05 0.07 66 R H H 115.95 6.95 17.54 25.96 91.86 90.06 -59.51 -41.88 1.34 0.00 98.65 0.46 0.14 0.57 98.47 0.36 0.00 0.00 0.00 67 K H H 131.13 1.63 22.51 22.40 91.84 50.20 -64.52 -40.51 0.37 0.00 99.63 0.06 0.02 0.22 99.50 0.20 0.00 0.00 0.00 68 E H H 34.80 14.77 18.34 33.48 91.99 49.72 -65.18 -41.57 0.20 0.00 99.80 0.03 0.01 0.11 99.65 0.19 0.00 0.00 0.00 69 I H H 23.42 17.62 17.74 35.39 91.77 50.34 -63.47 -42.38 0.11 0.00 99.89 0.02 0.01 0.06 99.88 0.04 0.00 0.00 0.00 70 Q H H 98.89 2.85 23.98 25.97 91.44 50.41 -63.59 -41.58 0.07 0.00 99.93 0.01 0.00 0.04 99.94 0.01 0.00 0.00 0.00 71 D H H 58.95 6.35 22.29 29.07 91.72 49.94 -64.54 -41.74 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 72 F H H 15.12 20.59 17.57 38.17 91.76 50.09 -63.77 -43.04 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 73 F H H 83.01 9.97 21.88 32.04 91.38 49.92 -63.72 -41.40 0.04 0.00 99.96 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 74 D H H 83.19 2.32 24.87 25.61 91.60 49.93 -64.26 -41.65 0.08 0.00 99.92 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 75 C H H 19.15 13.05 19.66 33.92 91.71 49.88 -64.06 -42.78 0.09 0.00 99.91 0.00 0.00 0.06 99.92 0.01 0.00 0.00 0.00 76 A H H 17.20 15.83 18.50 34.74 91.69 50.02 -63.48 -42.26 0.09 0.00 99.91 0.01 0.00 0.05 99.93 0.01 0.00 0.00 0.00 77 S H H 58.32 3.24 23.06 25.63 91.62 50.47 -63.90 -41.62 0.14 0.00 99.86 0.01 0.01 0.09 99.88 0.02 0.00 0.00 0.00 78 R H H 124.34 3.65 22.50 25.96 91.90 49.04 -64.95 -41.04 0.18 0.00 99.82 0.01 0.01 0.11 99.84 0.03 0.00 0.00 0.00 79 A H H 16.06 14.55 16.43 32.03 92.04 50.66 -64.07 -41.69 0.23 0.00 99.77 0.02 0.01 0.14 99.79 0.04 0.00 0.00 0.00 80 E H H 88.50 6.02 20.60 27.16 91.92 50.39 -64.23 -40.97 0.32 0.00 99.68 0.04 0.02 0.19 99.70 0.05 0.00 0.00 0.00 81 A H H 53.95 2.56 20.45 22.29 91.55 50.29 -64.40 -41.43 0.46 0.00 99.54 0.06 0.02 0.27 99.58 0.07 0.00 0.00 0.00 82 A H H 35.83 7.46 16.62 25.90 92.09 50.86 -64.74 -40.43 0.71 0.00 99.28 0.10 0.04 0.42 99.33 0.11 0.00 0.00 0.00 83 R H H 106.23 7.26 16.94 25.23 92.11 51.38 -64.79 -40.39 1.12 0.00 98.88 0.18 0.08 0.67 98.88 0.20 0.00 0.00 0.00 84 K H H 123.89 1.93 18.83 19.89 92.15 50.56 -65.03 -40.23 2.15 0.01 97.84 0.40 0.17 1.33 97.76 0.34 0.00 0.00 0.00 85 M H H 92.45 3.85 16.76 21.32 92.68 49.71 -66.65 -39.35 3.67 0.02 96.31 0.85 0.37 2.15 96.08 0.52 0.00 0.01 0.01 86 R H H 107.51 6.59 14.97 22.82 92.31 52.13 -65.30 -39.80 4.13 0.03 95.84 1.36 0.51 2.07 95.16 0.87 0.00 0.01 0.01 87 S H H 57.58 2.86 15.98 19.26 92.36 51.91 -65.29 -40.18 6.28 0.06 93.65 2.06 0.72 3.35 92.09 1.73 0.01 0.03 0.02 88 I H H 91.94 2.65 15.25 18.19 92.65 50.01 -66.98 -39.25 8.34 0.12 91.54 2.57 1.11 4.64 89.43 2.13 0.02 0.06 0.04 89 Q H H 83.51 5.86 12.15 19.71 93.29 51.53 -68.50 -35.30 12.51 0.19 87.30 4.67 1.94 6.19 84.53 2.49 0.02 0.09 0.08 90 E H H 120.83 3.49 12.40 17.32 93.34 56.01 -68.53 -34.41 22.03 0.26 77.70 6.34 3.05 12.87 73.46 4.00 0.03 0.13 0.12 91 N H H 127.49 1.06 12.98 13.62 95.87 51.15 -76.13 -19.18 35.29 0.37 64.34 8.38 4.96 22.47 59.59 4.18 0.05 0.17 0.20 92 L C H 108.97 3.24 10.37 15.03 100.07 55.16 -87.06 -7.52 56.44 0.69 42.87 14.87 15.38 27.07 37.94 3.97 0.07 0.24 0.45 93 G C C 50.35 2.45 12.76 16.34 110.90 -118.01 81.96 -158.82 86.03 0.88 13.09 35.86 19.44 31.52 5.84 6.42 0.00 0.38 0.54 94 E C C 136.28 3.33 12.07 16.93 109.26 -9.59 -86.60 112.46 84.67 1.72 13.62 54.48 14.66 15.33 4.14 9.53 0.00 0.90 0.96 95 L C C 101.50 6.38 10.66 18.56 110.14 109.71 -91.02 116.54 86.59 2.19 11.22 56.03 13.39 16.96 2.89 8.40 0.00 1.19 1.15 96 G C C 40.83 5.29 14.13 20.59 118.72 72.28 99.15 -170.15 91.24 2.62 6.14 52.42 21.17 17.46 1.10 5.33 0.00 1.41 1.11 97 S C C 80.67 4.09 15.43 20.91 113.38 -56.28 -96.43 126.49 93.96 3.49 2.55 64.24 23.81 5.80 0.62 2.03 0.00 1.66 1.85 98 L C C 39.85 16.43 9.31 25.22 117.36 -148.81 -90.73 136.75 97.48 2.35 0.18 80.17 17.01 0.21 0.10 0.06 0.00 0.75 1.70 99 P C C 64.87 3.43 17.92 21.77 115.48 -108.22 -67.06 152.86 99.72 0.16 0.12 99.44 0.32 0.05 0.08 0.01 0.00 0.04 0.06 100 P H H 81.95 7.94 12.32 21.70 91.73 -111.43 -57.73 -37.62 2.06 0.00 97.93 0.32 0.19 1.34 97.25 0.90 0.00 0.00 0.00 101 K H H 143.35 1.46 16.98 17.81 92.13 53.87 -64.70 -39.10 1.16 0.00 98.83 0.11 0.07 0.86 97.86 1.09 0.00 0.00 0.00 102 K H H 83.05 7.08 16.55 24.72 92.13 49.01 -65.85 -40.49 0.48 0.00 99.52 0.06 0.03 0.33 98.63 0.95 0.00 0.00 0.00 103 L H H 25.35 16.71 13.80 30.94 91.82 50.94 -63.10 -42.64 0.21 0.00 99.79 0.02 0.02 0.13 99.64 0.19 0.00 0.00 0.00 104 N H H 64.97 6.70 17.94 25.65 91.47 50.72 -64.09 -40.32 0.32 0.00 99.68 0.03 0.01 0.22 99.53 0.21 0.00 0.00 0.00 105 K H H 108.99 2.61 20.03 22.07 91.96 50.63 -64.54 -41.57 0.40 0.00 99.60 0.02 0.02 0.34 99.28 0.34 0.00 0.00 0.00 106 L H H 33.79 12.70 16.08 29.88 91.94 50.53 -63.86 -42.40 0.72 0.00 99.28 0.03 0.03 0.62 98.70 0.63 0.00 0.00 0.00 107 L H H 45.55 14.56 14.49 29.34 91.59 51.24 -65.86 -34.79 4.32 0.00 95.67 0.14 0.16 3.96 92.07 3.66 0.00 0.00 0.00 108 H H H 131.44 2.99 16.90 20.57 91.62 56.03 -67.53 -28.86 31.98 0.02 68.00 0.43 0.72 32.04 61.15 5.62 0.02 0.01 0.02 109 R H H 137.98 4.14 16.40 21.24 93.77 55.26 -75.14 -25.42 47.10 0.06 52.84 1.12 3.21 42.75 47.94 4.84 0.05 0.02 0.06 110 F C S 71.02 12.01 11.99 24.65 108.93 37.40 -121.59 70.89 95.81 0.76 3.43 29.22 63.69 2.80 2.81 0.55 0.00 0.17 0.76 111 P C C 65.93 8.94 12.22 22.53 110.09 152.21 -70.21 138.78 97.42 0.80 1.78 63.82 11.67 22.01 0.52 1.15 0.00 0.41 0.41 112 N C C 115.18 3.55 13.84 18.95 108.24 -83.45 -87.92 98.72 98.01 1.08 0.91 57.54 20.82 19.59 0.18 0.80 0.00 0.52 0.54 113 K C C 107.08 8.25 10.62 20.31 116.16 -164.63 -83.74 139.68 98.54 1.08 0.38 84.97 12.54 1.09 0.11 0.25 0.00 0.54 0.50 114 P C C 97.12 3.60 11.61 16.90 111.17 -111.88 -70.43 146.33 97.83 1.29 0.88 85.18 8.89 3.80 0.18 0.69 0.00 0.85 0.40 115 H C C 134.02 4.26 9.28 15.44 114.65 -130.69 -95.54 126.05 85.24 12.90 1.87 69.71 9.85 4.95 0.54 1.44 0.00 9.45 4.07 116 V C C 104.72 3.93 8.45 14.39 113.63 -163.38 -99.86 122.04 84.50 14.70 0.80 82.30 1.31 1.24 0.29 0.35 0.00 11.25 3.27 117 S C C 78.99 3.45 10.70 15.92 117.53 -162.88 -109.36 142.52 99.59 0.40 0.02 99.53 0.12 0.04 0.01 0.00 0.00 0.28 0.02